Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(NC(=O)C1=CC(NC(=O)NC2=CC=C(C=C2)C(C)=O)C(O)C(O)C1)C(C)C

InChIKey

InChIKey=RPSHECNCCWBSDG-UHFFFAOYSA-N

Formula

C22H29N3O7

Mass

447.488

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alpha-amino acid ester - Valine or derivatives - Alkyl-phenylketone - N-acyl-alpha amino acid or derivatives - N-phenylurea - Acetophenone - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Methyl ester - 1,2-diol - Carboxamide group - Carboxylic acid ester - Ketone - Urea - Secondary carboxylic acid amide - Carbonic acid derivative - Secondary alcohol - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

Previous Back Next